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Adaptive Spatially Aware I/O for Multiresolution Particle Data Layouts., , , , , , , , and . IPDPS, page 547-556. IEEE, (2021)Fast and Accurate Predictions of Total Energy for Solid Solution Alloys with Graph Convolutional Neural Networks., , , , and . SMC, volume 1512 of Communications in Computer and Information Science, page 79-98. Springer, (2021)Error correction in multi-fidelity molecular dynamics simulations using functional uncertainty quantification., and . J. Comput. Phys., (2017)ExaAM: Metal additive manufacturing simulation at the fidelity of the microstructure., , , , , , , , , and 10 other author(s). Int. J. High Perform. Comput. Appl., 36 (1): 13-39 (2022)Cabana: A Performance Portable Library for Particle-Based Simulations., , , , , , , , , and 6 other author(s). J. Open Source Softw., 7 (72): 4115 (2022)Enabling particle applications for exascale computing platforms., , , , , , , , , and 14 other author(s). CoRR, (2021)Implementing a neural network interatomic model with performance portability for emerging exascale architectures., , and . Comput. Phys. Commun., (2022)Computational Workflow for Accelerated Molecular Design Using Quantum Chemical Simulations and Deep Learning Models., , , , , , , and . SMC, volume 1690 of Communications in Computer and Information Science, page 3-19. Springer, (2022)Multi-task graph neural networks for simultaneous prediction of global and atomic properties in ferromagnetic systems *., , , and . Mach. Learn. Sci. Technol., 3 (2): 25007 (2022)A Sparse Distributed Gigascale Resolution Material Point Method., , , , , and . ACM Trans. Graph., 42 (2): 22:1-22:21 (April 2023)